Compound Identification
SMILES
OC1=C[N+](C\C=C\C2=C(N3[C@H](SC2)[C@H](NC(=O)CSC2=CC=CC=C2)C3=O)C([O-])=O)=CC=C1
InChIKey
InChIKey=QTQKJSRRVZLJDX-MYEWIJLCSA-N
Formula
C23H21N3O5S2
Mass
483.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Cephems
Direct Parent
Cephalosporins
Alternative Parents
N-acyl-alpha amino acids and derivatives Thiophenol ethers Alkylarylthioethers Hydroxypyridines 1,3-thiazines Benzene and substituted derivatives Pyridinium derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Azetidines Secondary carboxylic acid amides Carboxylic acid salts Dialkylthioethers Carboxylic acids Azacyclic compounds Sulfenyl compounds Thiohemiaminal derivatives Monocarboxylic acids and derivatives Organic zwitterions Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - Thiophenol ether - Hydroxypyridine - Alkylarylthioether - Meta-thiazine - Monocyclic benzene moiety - Pyridine - Pyridinium - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Sulfenyl compound - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Organic zwitterion - Organosulfur compound - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cephalosporins. These are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof.
External Descriptors
Not available